3-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[1-(3-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[1-(3-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C23H19BrN4 MolecularWeight: 431.32776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(N(C(=C3)C)C4=CC(=CC=C4)Br)C)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(N(C(=C3)C)C4=CC(=CC=C4)Br)C)C#N

InChI

InChI=1S/C23H19BrN4/c1-14-7-8-21-22(9-14)27-23(26-21)18(13-25)11-17-10-15(2)28(16(17)3)20-6-4-5-19(24)12-20/h4-12H,1-3H3,(H,26,27)